3-[(3-cyanophenyl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide

Systemtic Name: 3-[(3-cyanophenyl)sulfanylcarbamoylamino]-2-fluoranyl-4-phenyl-benzamide Openeye Name: 3-[(3-cyanophenyl)sulfanylcarbamoylamino]-2-fluoro-4-phenyl-benzamide CAS Name: 3-[[[[(3-cyanophenyl)thio]amino]-oxomethyl]amino]-2-fluoro-4-phenylbenzamide IUPAC Name: 3-[(3-cyanophenyl)sulfanylcarbamoylamino]-2-fluoro-4-phenylbenzamide Traditional Name: 3-[[(3-cyanophenyl)thio]carbamoylamino]-2-fluoro-4-phenyl-benzamide Formula: C21H15FN4O2S MolecularWeight: 406.432803

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)N)F)NC(=O)NSC3=CC=CC(=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=C(C=C2)C(=O)N)F)NC(=O)NSC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H15FN4O2S/c22-18-17(20(24)27)10-9-16(14-6-2-1-3-7-14)19(18)25-21(28)26-29-15-8-4-5-13(11-15)12-23/h1-11H,(H2,24,27)(H2,25,26,28)